Cyclohexanone-d₁₀ - ≥98%,≥98 atom% D , CAS No.51209-49-5

CAS: 51209-49-5 Cat. No.: C472020 Summenformel: C₆D₁₀O Molekulargewicht: 108.20 EG-Nummer: 257-058-7

GRADE & PURITY ≥98%,≥98 atom% D

Synonyms

SCHEMBL753633 | (2H10)Cyclohexanone | 2,2,3,3,4,4,5,5,6,6-Decadeuteriocyclohexan-1-one | CYCLOHEXANONE-D10-D | EINECS 257-058-7 | DTXSID80965481 | D99430 | d10-cyclohexanone

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

SCHEMBL753633 | (2H10)Cyclohexanone | 2,2,3,3,4,4,5,5,6,6-Decadeuteriocyclohexan-1-one | CYCLOHEXANONE-D10-D | EINECS 257-058-7 | DTXSID80965481 | D99430 | d10-cyclohexanone

Spezifikationen & Reinheit

≥98%,≥98 atom% D

Storage

Store at 2-8°C,Protected from light,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%,≥98 atom% D

Namen und Kennungen

• Kanonisches Lächeln: [2H]C1([2H])C(=O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C1([2H])[2H]
• IUPAC Name: 2,2,3,3,4,4,5,5,6,6-decadeuteriocyclohexan-1-one
• InChIKey: JHIVVAPYMSGYDF-YXALHFAPSA-N
• INCHI: 1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2/i1D2,2D2,3D2,4D2,5D2
• Isomere SMILES: [2H]C1(C(=O)C(C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H]
• Alternative CAS-Nummer: 108-94-1（unlabelled）
• UN-Nummer: 1915
• Verpackungsgruppe: III
• Molekulargewicht: 108.20
• Reaxy-Rn: 385735
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=385735&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Carbonyl compounds
        • Ebene5 Ketones
          • Ebene6 Cyclic ketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones
• Direct Parent: Cyclic ketones
• Alternative Parents: Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclic ketone - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light & Moisture Sensitive
• Siedepunkt (°C): 155° C (lit.)
• Schmelzpunkt (°C): -47° C (lit.)
• Molekulargewicht: 108.200 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 108.136 Da
• Monoisotopic Mass: 108.136 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 68.200
• Isotope Atom Count: 10
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). This product is isotopically enriched to ≥98 atom% deuterium. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 51209-49-5, the molecular formula is C6D10O, and the molecular weight is 108.20 g/mol. InChIKey JHIVVAPYMSGYDF-YXALHFAPSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.